N-ethyl-6-(4-methylpentoxy)pyridin-2-amine

C13H22N2O — CID 80862265

IUPACN-ethyl-6-(4-methylpentoxy)pyridin-2-amine
SMILESCCNc1cccc(OCCCC(C)C)n1
InChIInChI=1S/C13H22N2O/c1-4-14-12-8-5-9-13(15-12)16-10-6-7-11(2)3/h5,8-9,11H,4,6-7,10H2,1-3H3,(H,14,15)
InChIKeyDXOWXDQGGZOFMR-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.33
Rot. Bonds7

About N-ethyl-6-(4-methylpentoxy)pyridin-2-amine

N-ethyl-6-(4-methylpentoxy)pyridin-2-amine (PubChem CID 80862265) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-ethyl-6-(4-methylpentoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-(4-methylpentoxy)pyridin-2-amine
PubChem CID80862265
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-ethyl-6-(4-methylpentoxy)pyridin-2-amine
SMILESCCNc1cccc(OCCCC(C)C)n1
InChIInChI=1S/C13H22N2O/c1-4-14-12-8-5-9-13(15-12)16-10-6-7-11(2)3/h5,8-9,11H,4,6-7,10H2,1-3H3,(H,14,15)
InChIKeyDXOWXDQGGZOFMR-UHFFFAOYSA-N
XLogP3.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-butoxy-N-ethylpyridin-2-amine
CID 80867318
[6-(4-methylpentoxy)-2-pyridinyl]hydrazine
CID 80911157
N-ethyl-6-(2-propan-2-yloxyethoxy)pyridin-2-amine
CID 80860828
6-ethoxy-N-(4-methylpentyl)pyridin-2-amine
CID 63589684
6-(3-methylbutoxy)-N-propylpyridin-2-amine
CID 80859395
N-methyl-6-(3-methylbutoxy)pyridin-2-amine
CID 80859136
6-(3,3-dimethylbutoxy)-N-ethylpyridin-2-amine
CID 80878218
N-ethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridin-2-amine
CID 112590824
N-ethyl-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-2-amine
CID 104568139
N-ethyl-6-propan-2-yloxypyridin-2-amine
CID 80859521
N-ethyl-6-[2-(3-methoxypropoxy)ethoxy]pyridin-2-amine
CID 103176415
6-(2-cyclopropylethoxy)-N-ethylpyridin-2-amine
CID 106207426

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(4-methylpentoxy)pyridin-2-amine?
The IUPAC name of N-ethyl-6-(4-methylpentoxy)pyridin-2-amine (CID 80862265) is N-ethyl-6-(4-methylpentoxy)pyridin-2-amine.
What is the SMILES notation for N-ethyl-6-(4-methylpentoxy)pyridin-2-amine?
The canonical SMILES for N-ethyl-6-(4-methylpentoxy)pyridin-2-amine is CCNc1cccc(OCCCC(C)C)n1.
What is the InChIKey of N-ethyl-6-(4-methylpentoxy)pyridin-2-amine?
The InChIKey is DXOWXDQGGZOFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-14-12-8-5-9-13(15-12)16-10-6-7-11(2)3/h5,8-9,11H,4,6-7,10H2,1-3H3,(H,14,15).
What are the key properties of N-ethyl-6-(4-methylpentoxy)pyridin-2-amine?
N-ethyl-6-(4-methylpentoxy)pyridin-2-amine has a molecular weight of 222.33 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(4-methylpentoxy)pyridin-2-amine is sourced from PubChem (CID 80862265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).